1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide

C24H28N4O3 — CID 9325816

IUPAC1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide
SMILESCC[C@]1(c2ccccc2)NC(=O)N(CN2CCC(C(=O)Nc3ccccc3)CC2)C1=O
InChIInChI=1S/C24H28N4O3/c1-2-24(19-9-5-3-6-10-19)22(30)28(23(31)26-24)17-27-15-13-18(14-16-27)21(29)25-20-11-7-4-8-12-20/h3-12,18H,2,13-17H2,1H3,(H,25,29)(H,26,31)/t24-/m1/s1
InChIKeyWNWFYFHUDFFLDX-XMMPIXPASA-N
MW420.51 g/mol
LogP3.15
Rot. Bonds6

About 1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide

1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide (PubChem CID 9325816) has the molecular formula C24H28N4O3 and a molecular weight of 420.51 g/mol. Its IUPAC name is 1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide
PubChem CID9325816
Molecular FormulaC24H28N4O3
Molecular Weight420.51 g/mol
Exact Mass420.22
IUPAC Name1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide
SMILESCC[C@]1(c2ccccc2)NC(=O)N(CN2CCC(C(=O)Nc3ccccc3)CC2)C1=O
InChIInChI=1S/C24H28N4O3/c1-2-24(19-9-5-3-6-10-19)22(30)28(23(31)26-24)17-27-15-13-18(14-16-27)21(29)25-20-11-7-4-8-12-20/h3-12,18H,2,13-17H2,1H3,(H,25,29)(H,26,31)/t24-/m1/s1
InChIKeyWNWFYFHUDFFLDX-XMMPIXPASA-N
XLogP3.15
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.51
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

N-(1,3-benzodioxol-5-yl)-1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]piperidine-4-carboxamide
CID 31383243
(5R)-3-[[4-(azepane-1-carbonyl)piperidin-1-yl]methyl]-5-ethyl-5-phenylimidazolidine-2,4-dione
CID 9320030
methyl (2S)-4-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]thiomorpholine-2-carboxylate
CID 9233252
3-[[4-[(4-chlorophenyl)methyl]piperazin-1-yl]methyl]-5-ethyl-5-phenylimidazolidine-2,4-dione
CID 42911323
N-[1-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]piperidin-4-yl]cyclopropanecarboxamide
CID 36781248
N-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]oxane-4-carboxamide
CID 52528557
(5R)-3-[2-(azocan-1-yl)-2-oxoethyl]-5-ethyl-5-phenylimidazolidine-2,4-dione
CID 40748676
(3R)-1-[(8-tert-butyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)methyl]-N-phenylpiperidine-3-carboxamide
CID 26012258
N-[cyclopropyl(phenyl)methyl]-2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 51295946
2-[4-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]piperazin-1-yl]-N-phenylacetamide
CID 55511357
(5S)-3-[2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl]-5-ethyl-5-phenylimidazolidine-2,4-dione
CID 51434252
(5R)-3-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]-5-ethyl-5-phenylimidazolidine-2,4-dione
CID 124734823

Frequently Asked Questions

What is the IUPAC name of 1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide?
The IUPAC name of 1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide (CID 9325816) is 1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide?
The canonical SMILES for 1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide is CC[C@]1(c2ccccc2)NC(=O)N(CN2CCC(C(=O)Nc3ccccc3)CC2)C1=O.
What is the InChIKey of 1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide?
The InChIKey is WNWFYFHUDFFLDX-XMMPIXPASA-N. The full InChI is InChI=1S/C24H28N4O3/c1-2-24(19-9-5-3-6-10-19)22(30)28(23(31)26-24)17-27-15-13-18(14-16-27)21(29)25-20-11-7-4-8-12-20/h3-12,18H,2,13-17H2,1H3,(H,25,29)(H,26,31)/t24-/m1/s1.
What are the key properties of 1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide?
1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide has a molecular weight of 420.51 g/mol, XLogP of 3.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]-N-phenylpiperidine-4-carboxamide is sourced from PubChem (CID 9325816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).